2-(4-methylphenyl)-3-[[2,3,4,5-tetrakis(oxidanyl)oxan-2-yl]methylamino]quinazolin-4-one

Systemtic Name: 2-(4-methylphenyl)-3-[[2,3,4,5-tetrakis(oxidanyl)oxan-2-yl]methylamino]quinazolin-4-one Openeye Name: 2-(p-tolyl)-3-[(2,3,4,5-tetrahydroxytetrahydropyran-2-yl)methylamino]quinazolin-4-one CAS Name: 2-(4-methylphenyl)-3-[(2,3,4,5-tetrahydroxy-2-oxanyl)methylamino]-4-quinazolinone IUPAC Name: 2-(4-methylphenyl)-3-[(2,3,4,5-tetrahydroxyoxan-2-yl)methylamino]quinazolin-4-one Traditional Name: 2-(p-tolyl)-3-[(2,3,4,5-tetrahydroxytetrahydropyran-2-yl)methylamino]quinazolin-4-one Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NCC4(C(C(C(CO4)O)O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NCC4(C(C(C(CO4)O)O)O)O

InChI

InChI=1S/C21H23N3O6/c1-12-6-8-13(9-7-12)19-23-15-5-3-2-4-14(15)20(28)24(19)22-11-21(29)18(27)17(26)16(25)10-30-21/h2-9,16-18,22,25-27,29H,10-11H2,1H3